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1-piperidinecarboxylic acid, 4-[3-[[(3-chloro-4-fluorophenyl)amino]carbonyl]-7-hydroxypyrazolo[1,5-a]pyrimidin-5-yl]-, 1,1-
SpectraBase Compound ID 9eD9g724ysV
InChI InChI=1S/C23H25ClFN5O4/c1-23(2,3)34-22(33)29-8-6-13(7-9-29)18-11-19(31)30-20(28-18)15(12-26-30)21(32)27-14-4-5-17(25)16(24)10-14/h4-5,10-13,31H,6-9H2,1-3H3,(H,27,32)
InChIKey BCQKLGVGCVHQQH-UHFFFAOYSA-N
Mol Weight 489.94 g/mol
Molecular Formula C23H25ClFN5O4
Exact Mass 489.15791 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Ivc4I7iFg3P
Name 1-piperidinecarboxylic acid, 4-[3-[[(3-chloro-4-fluorophenyl)amino]carbonyl]-7-hydroxypyrazolo[1,5-a]pyrimidin-5-yl]-, 1,1-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 489.157910164 u
Formula C23H25ClFN5O4
InChI InChI=1S/C23H25ClFN5O4/c1-23(2,3)34-22(33)29-8-6-13(7-9-29)18-11-19(31)30-20(28-18)15(12-26-30)21(32)27-14-4-5-17(25)16(24)10-14/h4-5,10-13,31H,6-9H2,1-3H3,(H,27,32)
InChIKey BCQKLGVGCVHQQH-UHFFFAOYSA-N
Molecular Weight 489.935 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_2783
Solvent DMSO-d6
Source Vendor ID: NMR/12688931